Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GPR35 | Q9HC97 | 7/20 | 0.47 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.40 |
| ▸ | GALR3 | O60755 | 1/20 | 0.40 |
| ▸ | HTT | P42858 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | TSHR | P16473 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 2/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TTR | P02766 | 1/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | RECQL | P46063 | 1/20 | 0.38 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL28570533 | 0.77 | GPR35 (0.68) | GPR35ALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL17378837 | 0.74 | GPR35 (0.39) | GPR35ALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL6498479 | 0.72 | GPR35 (0.51) | GPR35ALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL18467780 | 0.72 | SMN1; SMN2 (0.44) | GPR35ALDH1A1MEN1KMT2ATDP1 | |
| Methyl Alcohol SCHEMBL29086960 | 0.72 | GPR35 (0.59) | GPR35ALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL4973651 | 0.72 | GPR35 (0.55) | GPR35ALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL8653042 | 0.71 | ALDH1A1 (0.38) | GPR35ALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL69964 | 0.71 | GPR35 (0.59) | GPR35ALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL1479104 | 0.71 | GPR35 (0.59) | GPR35ALDH1A1MEN1KMT2ATDP1 | |
| SCHEMBL10813721 | 0.71 | TSHR (0.39) | ALDH1A1MEN1KMT2ATDP1GALR3 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112661649-B | 2,6-dinitro-4-tert-amylphenol and preparation method thereof | 宁波龙欣精细化工有限公司 | 2023-01-10 | — | — | CN | disclosed |
| CN-112661649-A | 2, 6-dinitro-4-tert-amylphenol and preparation method thereof | 宁波龙欣精细化工有限公司 | 2021-04-16 | — | — | CN | disclosed |